Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 3/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | FLT4 | P35916 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7744215 | 0.89 | KDM4E (0.39) | KDM4EALDH1A1TDP1L3MBTL1NPC1 | |
| SCHEMBL7746666 | 0.73 | KDM4E (0.41) | KDM4EALDH1A1L3MBTL1MAPTNPC1 | |
| SCHEMBL7744109 | 0.71 | KDR (0.54) | CYP11B1CYP11B2FLT1FLT4KDR | |
| SCHEMBL7969128 | 0.70 | NOX1 (0.48) | KDM4EALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL7982509 | 0.66 | KDR (0.52) | KDM4EMAPTNPC1RAB9APKM | |
| SCHEMBL30644242 | 0.66 | KDM4E (0.53) | KDM4EALDH1A1TDP1L3MBTL1MAPT | |
| SCHEMBL10816949 | 0.66 | KDM4E (0.53) | KDM4EALDH1A1TDP1L3MBTL1MAPT | |
| SCHEMBL7982226 | 0.64 | KDR (0.49) | KDM4EALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL28377822 | 0.63 | TOP2A (0.38) | KDM4EALDH1A1NPC1RAB9AMAPK1 | |
| SCHEMBL5604821 | 0.61 | HTR6 (0.56) | KDM4EALDH1A1L3MBTL1NPC1RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6228871-B1 | THIAZOLE OR OXAZOLE DERIVATIVE TYROSINE KINASE INHIBITORS; ANTICARCINOGENIC AGENTS; AUTOIMMUNE DISEASES; DIABETIC RETINOPATHY | MERCK & CO., INC. | 2001-05-08 | — | — | US | disclosed |